ethyl 4-azanyl-2-[2-oxidanylidene-2-(2-oxidanylideneoxolan-3-yl)oxy-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-oxidanylidene-2-(2-oxidanylideneoxolan-3-yl)oxy-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-oxo-2-(2-oxotetrahydrofuran-3-yl)oxy-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-oxo-2-[(2-oxo-3-oxolanyl)oxy]ethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-oxo-2-(2-oxooxolan-3-yl)oxyethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-keto-2-(2-ketotetrahydrofuran-3-yl)oxy-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C13H15N3O6S MolecularWeight: 341.3397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OC2CCOC2=O

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OC2CCOC2=O

InChI

InChI=1S/C13H15N3O6S/c1-2-20-11(18)7-5-15-13(16-10(7)14)23-6-9(17)22-8-3-4-21-12(8)19/h5,8H,2-4,6H2,1H3,(H2,14,15,16)